[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate

Systemtic Name: [2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate Openeye Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl] thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl] thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid [2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl] ester Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCNC(=O)COC(=O)C2=CSC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCNC(=O)COC(=O)C2=CSC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O5S/c19-14(9-23-15(20)11-5-8-24-10-11)17-7-6-16-12-1-3-13(4-2-12)18(21)22/h1-5,8,10,16H,6-7,9H2,(H,17,19)